(3S)-1-oxidanylidene-3-phenyl-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile

Systemtic Name: (3S)-1-oxidanylidene-3-phenyl-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile Openeye Name: (3S)-1-oxo-3-phenyl-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile CAS Name: (3S)-1-oxo-3-phenyl-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile IUPAC Name: (3S)-1-oxo-3-phenyl-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile Traditional Name: (3S)-1-keto-3-phenyl-3-(trifluoromethyl)-2,5-dihydropyrimido[1,6-a]benzimidazole-4-carbonitrile Formula: C18H11F3N4O MolecularWeight: 356.30135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(=C3NC4=CC=CC=C4N3C(=O)N2)C#N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)[C@]2(C(=C3NC4=CC=CC=C4N3C(=O)N2)C#N)C(F)(F)F

InChI

InChI=1S/C18H11F3N4O/c19-18(20,21)17(11-6-2-1-3-7-11)12(10-22)15-23-13-8-4-5-9-14(13)25(15)16(26)24-17/h1-9,23H,(H,24,26)/t17-/m0/s1